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Substance Name: Anthranilic acid, N-m-nitrophenyl-
RN: 27693-70-5
InChIKey: NBJRFLIUYUFOIR-UHFFFAOYSA-N

Molecular Formula

  • C13-H10-N2-O4

Molecular Weight

  • 258.232
 
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Names and Synonyms

Synonyms

  • 4-14-00-01020 (Beilstein Handbook Reference)
  • Anthranilic acid, N-(m-nitrophenyl)-
  • BRN 2750166
  • N-m-Nitrophenylanthranilic acid
  • NSC 509690

Systematic Names

  • Anthranilic acid, N-m-nitrophenyl-
  • Benzoic acid, 2-((3-nitrophenyl)amino)- (9CI)

Registry Numbers

CAS Registry Number

  • 27693-70-5

System Generated Number

  • 0027693705

Structure Descriptors

InChI

1S/C13H10N2O4/c16-13(17)11-6-1-2-7-12(11)14-9-4-3-5-10(8-9)15(18)19/h1-8,14H,(H,16,17)

InChIKey

NBJRFLIUYUFOIR-UHFFFAOYSA-N

Smiles

[N+](c1cc(Nc2c(C(=O)O)cccc2)ccc1)([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 202mg/kg (202mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 89, Pg. 1392, 1969.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 4.57 (none)   EXP
Water Solubility 2.660 mg/L 25 EST
Vapor Pressure 3.63E-08 mm Hg 25 EST
Henry's Law Constant 8.34E-14 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.76E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.